⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL979796 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL5666922 | 0.94 | — | — | |
| Sulfuric Acid Diethyl Ester SCHEMBL28198550 | 0.94 | CA1 (0.46) | — | |
| SCHEMBL28520917 | 0.94 | — | — | |
| Trimethylammonium SCHEMBL29003447 | 0.89 | CA1 (0.42) | — | |
| Ethylamine SCHEMBL20699267 | 0.89 | CA1 (0.48) | — | |
| Sulfuric Acid Diethyl Ester SCHEMBL11137655 | 0.88 | CA1 (0.46) | — | |
| Sulfuric Acid Diethyl Ester SCHEMBL28919288 | 0.84 | CA1 (0.53) | — | |
| SCHEMBL28404596 | 0.81 | CA1 (0.41) | — | |
| Monoethanolamine SCHEMBL28404594 | 0.81 | CA1 (0.41) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107394269-A | Electrolyte and lithium ion battery | 宁德新能源科技有限公司 | 2017-11-24 | — | — | CN | claimed |
| CN-105074996-A | Nonaqueous electrolyte solution and electricity storage device using same | UBE INDUSTRIES | 2015-11-18 | — | — | CN | claimed |
| CN-107394269-A | Electrolyte and lithium ion battery | 宁德新能源科技有限公司 | 2017-11-24 | — | — | CN | disclosed |
| CN-105074996-B | Nonaqueous electrolytic solution and the electric energy storage device for having used the nonaqueous electrolytic solution | 宇部兴产株式会社 | 2017-10-03 | — | — | CN | disclosed |
| CN-105074996-A | Nonaqueous electrolyte solution and electricity storage device using same | UBE INDUSTRIES | 2015-11-18 | — | — | CN | disclosed |